1-[1-adamantyl-(4-chloranyl-2-methyl-phenyl)methyl]adamantane

Systemtic Name: 1-[1-adamantyl-(4-chloranyl-2-methyl-phenyl)methyl]adamantane Openeye Name: 1-[1-adamantyl-(4-chloro-2-methyl-phenyl)methyl]adamantane CAS Name: 1-[1-adamantyl-(4-chloro-2-methylphenyl)methyl]adamantane IUPAC Name: 1-[1-adamantyl-(4-chloro-2-methylphenyl)methyl]adamantane Traditional Name: 1-[1-adamantyl-(4-chloro-2-methyl-phenyl)methyl]adamantane Formula: C28H37Cl MolecularWeight: 409.04638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)C(C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)C(C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C28H37Cl/c1-17-4-24(29)2-3-25(17)26(27-11-18-5-19(12-27)7-20(6-18)13-27)28-14-21-8-22(15-28)10-23(9-21)16-28/h2-4,18-23,26H,5-16H2,1H3